Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 6/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ADH1A | P07327 | 2/20 | 0.40 |
| ▸ | ADH1C | P00326 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28452777 | 0.98 | EPHX1 (0.47) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL3931071 | 0.74 | PKM (0.44) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL9547549 | 0.74 | EPHX1 (0.54) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL11686785 | 0.73 | ADH1A (0.48) | ALDH1A1ADH1AADH1C | |
| SCHEMBL7022369 | 0.72 | CCR5 (0.50) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL3483050 | 0.72 | ADRA2A (0.42) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11771542 | 0.71 | ADH1A (0.46) | ALDH1A1ADH1AADH1C | |
| SCHEMBL3093421 | 0.71 | ADH1A (0.48) | ALDH1A1ADH1AADH1C | |
| SCHEMBL11771534 | 0.71 | ADH1A (0.46) | ALDH1A1ADH1AADH1C | |
| SCHEMBL9538240 | 0.71 | EPHX1 (0.50) | EPHX1NPC1SMN1; SMN2RAB9AALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1474419-A1 | AMIDES OF AMINOALKYL-SUBSTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES | NOVO NORDISK A/S (DK) | 2004-11-10 | — | — | EP | disclosed |
| WO-2003064411-A1 | AMIDES OF AMINOALKYL-SUBSTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES | NOVO NORDISK A/S (DK) | 2003-08-07 | — | — | WO | disclosed |